Name: Name:6-(4-methoxyphenyl)-2-(trifluoromethyl)imidazo[2,1-b][1,3,4]thiadiazole
Brand: Angene
SKU: AG01BUV5
Rating: 90 (10 reviews)

6-(4-methoxyphenyl)-2-(trifluoromethyl)imidazo[2,1-b][1,3,4]thiadiazole

CAS No.:

798573-42-9

Catalog Number:

AG01BUV5

Molecular Formula:

C12H8F3N3OS

Molecular Weight:

299.2716

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Product Description

Catalog Number:

AG01BUV5

Chemical Name:

6-(4-methoxyphenyl)-2-(trifluoromethyl)imidazo[2,1-b][1,3,4]thiadiazole

CAS Number:

798573-42-9

Molecular Formula:

C12H8F3N3OS

Molecular Weight:

299.2716

MDL Number:

MFCD22573790

IUPAC Name:

6-(4-methoxyphenyl)-2-(trifluoromethyl)imidazo[2,1-b][1,3,4]thiadiazole

InChI:

InChI=1S/C12H8F3N3OS/c1-19-8-4-2-7(3-5-8)9-6-18-11(16-9)20-10(17-18)12(13,14)15/h2-6H,1H3

InChI Key:

FTNHMTKQDPGOAJ-UHFFFAOYSA-N

SMILES:

COc1ccc(cc1)c1cn2c(n1)sc(n2)C(F)(F)F

Properties

Complexity:

349

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

299.034g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

299.271g/mol

Monoisotopic Mass:

299.034g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

67.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.4

Literature

Title	Journal
Synthesis and anti-tubercular activity of a series of 2-sulfonamido/trifluoromethyl-6-substituted imidazo[2,1-b]-1,3,4-thiadiazole derivatives.	Bioorganic & medicinal chemistry 20041101